Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1NC1=NC(=CS1)C(=O)OCC(=O)C1=CC=CC=C1

InChIKey

InChIKey=ANOQAOKJCKSKPU-UHFFFAOYSA-N

Formula

C18H13ClN2O3S

Mass

372.82

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Benzoyl - Thiazolecarboxylic acid or derivatives - Aryl alkyl ketone - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 1,3-thiazol-2-amine - Thiazole - Azole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organochloride - Organonitrogen compound - Amine - Organic oxide - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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